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(2-cyano-4-heptyl-phenyl) 4-(4-octylcyclohexyl)benzoate

(2-cyano-4-heptyl-phenyl) 4-(4-octylcyclohexyl)benzoate

Systemtic Name:(2-cyano-4-heptyl-phenyl) 4-(4-octylcyclohexyl)benzoate
Openeye Name:(2-cyano-4-heptyl-phenyl) 4-(4-octylcyclohexyl)benzoate
CAS Name:4-(4-octylcyclohexyl)benzoic acid (2-cyano-4-heptylphenyl) ester
IUPAC Name:(2-cyano-4-heptylphenyl) 4-(4-octylcyclohexyl)benzoate
Traditional Name:4-(4-octylcyclohexyl)benzoic acid (2-cyano-4-heptyl-phenyl) ester
Formula: C35H49NO2
MolecularWeight: 515.76906
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CCCCCCC)C#N


Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CCCCCCC)C#N


InChI

InChI=1S/C35H49NO2/c1-3-5-7-9-11-12-14-28-16-19-30(20-17-28)31-21-23-32(24-22-31)35(37)38-34-25-18-29(26-33(34)27-36)15-13-10-8-6-4-2/h18,21-26,28,30H,3-17,19-20H2,1-2H3


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